6-(3-dibenzofuran-2-yl-5-dibenzothiophen-2-ylphenyl)-N,N-bis(4-phenylphenyl)pyridin-3-amine;2-(3-dibenzofuran-2-yl-5-dibenzothiophen-2-ylphenyl)-N,N-bis(4-phenylphenyl)pyrimidin-5-amine;N-[4-(3-dibenzofuran-2-yl-5-dibenzothiophen-2-ylphenyl)phenyl]-4-naphthalen-2-yl-N-(4-naphthalen-2-ylphenyl)aniline

C185H118N6O3S3 — CID 158905331

IUPAC6-(3-dibenzofuran-2-yl-5-dibenzothiophen-2-ylphenyl)-N,N-bis(4-phenylphenyl)pyridin-3-amine;2-(3-dibenzofuran-2-yl-5-dibenzothiophen-2-ylphenyl)-N,N-bis(4-phenylphenyl)pyrimidin-5-amine;N-[4-(3-dibenzofuran-2-yl-5-dibenzothiophen-2-ylphenyl)phenyl]-4-naphthalen-2-yl-N-(4-naphthalen-2-ylphenyl)aniline
SMILESc1ccc(-c2ccc(N(c3ccc(-c4ccccc4)cc3)c3ccc(-c4cc(-c5ccc6oc7ccccc7c6c5)cc(-c5ccc6sc7ccccc7c6c5)c4)nc3)cc2)cc1.c1ccc(-c2ccc(N(c3ccc(-c4ccccc4)cc3)c3cnc(-c4cc(-c5ccc6oc7ccccc7c6c5)cc(-c5ccc6sc7ccccc7c6c5)c4)nc3)cc2)cc1.c1ccc2cc(-c3ccc(N(c4ccc(-c5cc(-c6ccc7oc8ccccc8c7c6)cc(-c6ccc7sc8ccccc8c7c6)c5)cc4)c4ccc(-c5ccc6ccccc6c5)cc4)cc3)ccc2c1
InChIInChI=1S/C68H43NOS.C59H38N2OS.C58H37N3OS/c1-3-11-49-37-51(19-17-44(49)9-1)46-21-29-58(30-22-46)69(59-31-23-47(24-32-59)52-20-18-45-10-2-4-12-50(45)38-52)60-33-25-48(26-34-60)55-39-56(53-27-35-66-63(42-53)61-13-5-7-15-65(61)70-66)41-57(40-55)54-28-36-68-64(43-54)62-14-6-8-16-67(62)71-68;1-3-11-39(12-4-1)41-19-25-48(26-20-41)61(49-27-21-42(22-28-49)40-13-5-2-6-14-40)50-29-30-55(60-38-50)47-34-45(43-23-31-57-53(36-43)51-15-7-9-17-56(51)62-57)33-46(35-47)44-24-32-59-54(37-44)52-16-8-10-18-58(52)63-59;1-3-11-38(12-4-1)40-19-25-47(26-20-40)61(48-27-21-41(22-28-48)39-13-5-2-6-14-39)49-36-59-58(60-37-49)46-32-44(42-23-29-55-52(34-42)50-15-7-9-17-54(50)62-55)31-45(33-46)43-24-30-57-53(35-43)51-16-8-10-18-56(51)63-57/h1-43H;1-38H;1-37H
InChIKeyJFYXQGPUONYEJK-UHFFFAOYSA-N
MW2569.22 g/mol
LogP53.77
Rot. Bonds24

About 6-(3-dibenzofuran-2-yl-5-dibenzothiophen-2-ylphenyl)-N,N-bis(4-phenylphenyl)pyridin-3-amine;2-(3-dibenzofuran-2-yl-5-dibenzothiophen-2-ylphenyl)-N,N-bis(4-phenylphenyl)pyrimidin-5-amine;N-[4-(3-dibenzofuran-2-yl-5-dibenzothiophen-2-ylphenyl)phenyl]-4-naphthalen-2-yl-N-(4-naphthalen-2-ylphenyl)aniline

6-(3-dibenzofuran-2-yl-5-dibenzothiophen-2-ylphenyl)-N,N-bis(4-phenylphenyl)pyridin-3-amine;2-(3-dibenzofuran-2-yl-5-dibenzothiophen-2-ylphenyl)-N,N-bis(4-phenylphenyl)pyrimidin-5-amine;N-[4-(3-dibenzofuran-2-yl-5-dibenzothiophen-2-ylphenyl)phenyl]-4-naphthalen-2-yl-N-(4-naphthalen-2-ylphenyl)aniline (PubChem CID 158905331) has the molecular formula C185H118N6O3S3 and a molecular weight of 2569.22 g/mol. Its IUPAC name is 6-(3-dibenzofuran-2-yl-5-dibenzothiophen-2-ylphenyl)-N,N-bis(4-phenylphenyl)pyridin-3-amine;2-(3-dibenzofuran-2-yl-5-dibenzothiophen-2-ylphenyl)-N,N-bis(4-phenylphenyl)pyrimidin-5-amine;N-[4-(3-dibenzofuran-2-yl-5-dibenzothiophen-2-ylphenyl)phenyl]-4-naphthalen-2-yl-N-(4-naphthalen-2-ylphenyl)aniline.

Molecular Properties

Compound Name6-(3-dibenzofuran-2-yl-5-dibenzothiophen-2-ylphenyl)-N,N-bis(4-phenylphenyl)pyridin-3-amine;2-(3-dibenzofuran-2-yl-5-dibenzothiophen-2-ylphenyl)-N,N-bis(4-phenylphenyl)pyrimidin-5-amine;N-[4-(3-dibenzofuran-2-yl-5-dibenzothiophen-2-ylphenyl)phenyl]-4-naphthalen-2-yl-N-(4-naphthalen-2-ylphenyl)aniline
PubChem CID158905331
Molecular FormulaC185H118N6O3S3
Molecular Weight2569.22 g/mol
Exact Mass2566.84
IUPAC Name6-(3-dibenzofuran-2-yl-5-dibenzothiophen-2-ylphenyl)-N,N-bis(4-phenylphenyl)pyridin-3-amine;2-(3-dibenzofuran-2-yl-5-dibenzothiophen-2-ylphenyl)-N,N-bis(4-phenylphenyl)pyrimidin-5-amine;N-[4-(3-dibenzofuran-2-yl-5-dibenzothiophen-2-ylphenyl)phenyl]-4-naphthalen-2-yl-N-(4-naphthalen-2-ylphenyl)aniline
SMILESc1ccc(-c2ccc(N(c3ccc(-c4ccccc4)cc3)c3ccc(-c4cc(-c5ccc6oc7ccccc7c6c5)cc(-c5ccc6sc7ccccc7c6c5)c4)nc3)cc2)cc1.c1ccc(-c2ccc(N(c3ccc(-c4ccccc4)cc3)c3cnc(-c4cc(-c5ccc6oc7ccccc7c6c5)cc(-c5ccc6sc7ccccc7c6c5)c4)nc3)cc2)cc1.c1ccc2cc(-c3ccc(N(c4ccc(-c5cc(-c6ccc7oc8ccccc8c7c6)cc(-c6ccc7sc8ccccc8c7c6)c5)cc4)c4ccc(-c5ccc6ccccc6c5)cc4)cc3)ccc2c1
InChIInChI=1S/C68H43NOS.C59H38N2OS.C58H37N3OS/c1-3-11-49-37-51(19-17-44(49)9-1)46-21-29-58(30-22-46)69(59-31-23-47(24-32-59)52-20-18-45-10-2-4-12-50(45)38-52)60-33-25-48(26-34-60)55-39-56(53-27-35-66-63(42-53)61-13-5-7-15-65(61)70-66)41-57(40-55)54-28-36-68-64(43-54)62-14-6-8-16-67(62)71-68;1-3-11-39(12-4-1)41-19-25-48(26-20-41)61(49-27-21-42(22-28-49)40-13-5-2-6-14-40)50-29-30-55(60-38-50)47-34-45(43-23-31-57-53(36-43)51-15-7-9-17-56(51)62-57)33-46(35-47)44-24-32-59-54(37-44)52-16-8-10-18-58(52)63-59;1-3-11-38(12-4-1)40-19-25-47(26-20-40)61(48-27-21-41(22-28-48)39-13-5-2-6-14-39)49-36-59-58(60-37-49)46-32-44(42-23-29-55-52(34-42)50-15-7-9-17-54(50)62-55)31-45(33-46)43-24-30-57-53(35-43)51-16-8-10-18-56(51)63-57/h1-43H;1-38H;1-37H
InChIKeyJFYXQGPUONYEJK-UHFFFAOYSA-N
XLogP53.77
TPSA87.81 Ų
H-Bond Donors
H-Bond Acceptors12
Rotatable Bonds24
Heavy Atoms197
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002569.22
LogP ≤ 553.77
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1012

Analyze 6-(3-dibenzofuran-2-yl-5-dibenzothiophen-2-ylphenyl)-N,N-bis(4-phenylphenyl)pyridin-3-amine;2-(3-dibenzofuran-2-yl-5-dibenzothiophen-2-ylphenyl)-N,N-bis(4-phenylphenyl)pyrimidin-5-amine;N-[4-(3-dibenzofuran-2-yl-5-dibenzothiophen-2-ylphenyl)phenyl]-4-naphthalen-2-yl-N-(4-naphthalen-2-ylphenyl)aniline with MolForge

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Related Compounds

4-dibenzofuran-2-yl-6-(3-dibenzothiophen-2-yl-5-naphthalen-2-ylphenyl)-2-phenylpyrimidine
CID 171585383
bis(4-dibenzofuran-2-yl-N-(4-dibenzothiophen-2-ylphenyl)-N-phenylaniline);N-(4-dibenzofuran-2-ylphenyl)-N-(4-dibenzothiophen-2-ylphenyl)-3,5-diphenylaniline;N-(4-dibenzofuran-2-ylphenyl)-N-(4-dibenzothiophen-2-ylphenyl)naphthalen-1-amine;N-(4-dibenzofuran-2-ylphenyl)-N-(4-dibenzothiophen-2-ylphenyl)naphthalen-2-amine;N-(4-dibenzofuran-2-ylphenyl)-N-(4-dibenzothiophen-2-ylphenyl)-4-phenylaniline
CID 158888724
N-[4-(3-dibenzofuran-2-yl-5-dibenzothiophen-2-ylphenyl)phenyl]-N-(4-phenylphenyl)naphthalen-1-amine
CID 121383334
5-(3-dibenzofuran-2-yl-5-dibenzothiophen-2-ylphenyl)-1-N,1-N,3-N,3-N-tetrakis(4-phenylphenyl)benzene-1,3-diamine
CID 121383373
N-[4-(3-dibenzofuran-2-yl-5-dibenzothiophen-2-ylphenyl)phenyl]-N-phenylnaphthalen-1-amine
CID 121383327
4-dibenzofuran-2-yl-N,N-bis(4-dibenzothiophen-2-ylphenyl)aniline;4-dibenzothiophen-2-yl-N,N-bis(4-dibenzothiophen-2-ylphenyl)aniline
CID 157275659
8-dibenzofuran-2-yl-N-(3,5-diphenylphenyl)-N-(4-phenylphenyl)dibenzofuran-2-amine;8-dibenzofuran-2-yl-N-naphthalen-1-yl-N-[4-(4-phenylphenyl)phenyl]dibenzothiophen-2-amine;8-dibenzothiophen-2-yl-N-(4-phenylphenyl)-N-[4-(3-phenylphenyl)phenyl]dibenzothiophen-2-amine
CID 161143692
N-(3-dibenzothiophen-2-ylphenyl)-N-(3-naphthalen-2-ylphenyl)dibenzofuran-3-amine
CID 163950326
N-(4-dibenzothiophen-2-ylphenyl)-N-[4-(3-naphthalen-2-ylphenyl)phenyl]dibenzothiophen-2-amine
CID 166565819
N-(4-dibenzofuran-2-ylphenyl)-N-[4-(3-phenylphenyl)phenyl]naphthalen-2-amine
CID 118405802
7-N-dibenzothiophen-3-yl-2-N,7-N-diphenyl-2-N-(4-phenylphenyl)dibenzofuran-2,7-diamine;7-N-dibenzothiophen-3-yl-7-N-(4-naphthalen-2-ylphenyl)-3-N,3-N-diphenyldibenzofuran-3,7-diamine;7-N-dibenzothiophen-3-yl-2-N,2-N,7-N-triphenyldibenzofuran-2,7-diamine
CID 158872648
4-dibenzothiophen-2-yl-2-[3,5-di(dibenzofuran-2-yl)phenyl]-6-phenylpyrimidine
CID 137465858

Frequently Asked Questions

What is the IUPAC name of 6-(3-dibenzofuran-2-yl-5-dibenzothiophen-2-ylphenyl)-N,N-bis(4-phenylphenyl)pyridin-3-amine;2-(3-dibenzofuran-2-yl-5-dibenzothiophen-2-ylphenyl)-N,N-bis(4-phenylphenyl)pyrimidin-5-amine;N-[4-(3-dibenzofuran-2-yl-5-dibenzothiophen-2-ylphenyl)phenyl]-4-naphthalen-2-yl-N-(4-naphthalen-2-ylphenyl)aniline?
The IUPAC name of 6-(3-dibenzofuran-2-yl-5-dibenzothiophen-2-ylphenyl)-N,N-bis(4-phenylphenyl)pyridin-3-amine;2-(3-dibenzofuran-2-yl-5-dibenzothiophen-2-ylphenyl)-N,N-bis(4-phenylphenyl)pyrimidin-5-amine;N-[4-(3-dibenzofuran-2-yl-5-dibenzothiophen-2-ylphenyl)phenyl]-4-naphthalen-2-yl-N-(4-naphthalen-2-ylphenyl)aniline (CID 158905331) is 6-(3-dibenzofuran-2-yl-5-dibenzothiophen-2-ylphenyl)-N,N-bis(4-phenylphenyl)pyridin-3-amine;2-(3-dibenzofuran-2-yl-5-dibenzothiophen-2-ylphenyl)-N,N-bis(4-phenylphenyl)pyrimidin-5-amine;N-[4-(3-dibenzofuran-2-yl-5-dibenzothiophen-2-ylphenyl)phenyl]-4-naphthalen-2-yl-N-(4-naphthalen-2-ylphenyl)aniline.
What is the SMILES notation for 6-(3-dibenzofuran-2-yl-5-dibenzothiophen-2-ylphenyl)-N,N-bis(4-phenylphenyl)pyridin-3-amine;2-(3-dibenzofuran-2-yl-5-dibenzothiophen-2-ylphenyl)-N,N-bis(4-phenylphenyl)pyrimidin-5-amine;N-[4-(3-dibenzofuran-2-yl-5-dibenzothiophen-2-ylphenyl)phenyl]-4-naphthalen-2-yl-N-(4-naphthalen-2-ylphenyl)aniline?
The canonical SMILES for 6-(3-dibenzofuran-2-yl-5-dibenzothiophen-2-ylphenyl)-N,N-bis(4-phenylphenyl)pyridin-3-amine;2-(3-dibenzofuran-2-yl-5-dibenzothiophen-2-ylphenyl)-N,N-bis(4-phenylphenyl)pyrimidin-5-amine;N-[4-(3-dibenzofuran-2-yl-5-dibenzothiophen-2-ylphenyl)phenyl]-4-naphthalen-2-yl-N-(4-naphthalen-2-ylphenyl)aniline is c1ccc(-c2ccc(N(c3ccc(-c4ccccc4)cc3)c3ccc(-c4cc(-c5ccc6oc7ccccc7c6c5)cc(-c5ccc6sc7ccccc7c6c5)c4)nc3)cc2)cc1.c1ccc(-c2ccc(N(c3ccc(-c4ccccc4)cc3)c3cnc(-c4cc(-c5ccc6oc7ccccc7c6c5)cc(-c5ccc6sc7ccccc7c6c5)c4)nc3)cc2)cc1.c1ccc2cc(-c3ccc(N(c4ccc(-c5cc(-c6ccc7oc8ccccc8c7c6)cc(-c6ccc7sc8ccccc8c7c6)c5)cc4)c4ccc(-c5ccc6ccccc6c5)cc4)cc3)ccc2c1.
What is the InChIKey of 6-(3-dibenzofuran-2-yl-5-dibenzothiophen-2-ylphenyl)-N,N-bis(4-phenylphenyl)pyridin-3-amine;2-(3-dibenzofuran-2-yl-5-dibenzothiophen-2-ylphenyl)-N,N-bis(4-phenylphenyl)pyrimidin-5-amine;N-[4-(3-dibenzofuran-2-yl-5-dibenzothiophen-2-ylphenyl)phenyl]-4-naphthalen-2-yl-N-(4-naphthalen-2-ylphenyl)aniline?
The InChIKey is JFYXQGPUONYEJK-UHFFFAOYSA-N. The full InChI is InChI=1S/C68H43NOS.C59H38N2OS.C58H37N3OS/c1-3-11-49-37-51(19-17-44(49)9-1)46-21-29-58(30-22-46)69(59-31-23-47(24-32-59)52-20-18-45-10-2-4-12-50(45)38-52)60-33-25-48(26-34-60)55-39-56(53-27-35-66-63(42-53)61-13-5-7-15-65(61)70-66)41-57(40-55)54-28-36-68-64(43-54)62-14-6-8-16-67(62)71-68;1-3-11-39(12-4-1)41-19-25-48(26-20-41)61(49-27-21-42(22-28-49)40-13-5-2-6-14-40)50-29-30-55(60-38-50)47-34-45(43-23-31-57-53(36-43)51-15-7-9-17-56(51)62-57)33-46(35-47)44-24-32-59-54(37-44)52-16-8-10-18-58(52)63-59;1-3-11-38(12-4-1)40-19-25-47(26-20-40)61(48-27-21-41(22-28-48)39-13-5-2-6-14-39)49-36-59-58(60-37-49)46-32-44(42-23-29-55-52(34-42)50-15-7-9-17-54(50)62-55)31-45(33-46)43-24-30-57-53(35-43)51-16-8-10-18-56(51)63-57/h1-43H;1-38H;1-37H.
What are the key properties of 6-(3-dibenzofuran-2-yl-5-dibenzothiophen-2-ylphenyl)-N,N-bis(4-phenylphenyl)pyridin-3-amine;2-(3-dibenzofuran-2-yl-5-dibenzothiophen-2-ylphenyl)-N,N-bis(4-phenylphenyl)pyrimidin-5-amine;N-[4-(3-dibenzofuran-2-yl-5-dibenzothiophen-2-ylphenyl)phenyl]-4-naphthalen-2-yl-N-(4-naphthalen-2-ylphenyl)aniline?
6-(3-dibenzofuran-2-yl-5-dibenzothiophen-2-ylphenyl)-N,N-bis(4-phenylphenyl)pyridin-3-amine;2-(3-dibenzofuran-2-yl-5-dibenzothiophen-2-ylphenyl)-N,N-bis(4-phenylphenyl)pyrimidin-5-amine;N-[4-(3-dibenzofuran-2-yl-5-dibenzothiophen-2-ylphenyl)phenyl]-4-naphthalen-2-yl-N-(4-naphthalen-2-ylphenyl)aniline has a molecular weight of 2569.22 g/mol, XLogP of 53.77, 24 rotatable bonds, 0 hydrogen bond donors, and 12 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(3-dibenzofuran-2-yl-5-dibenzothiophen-2-ylphenyl)-N,N-bis(4-phenylphenyl)pyridin-3-amine;2-(3-dibenzofuran-2-yl-5-dibenzothiophen-2-ylphenyl)-N,N-bis(4-phenylphenyl)pyrimidin-5-amine;N-[4-(3-dibenzofuran-2-yl-5-dibenzothiophen-2-ylphenyl)phenyl]-4-naphthalen-2-yl-N-(4-naphthalen-2-ylphenyl)aniline is sourced from PubChem (CID 158905331), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).